MDA 77

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Systematic / IUPAC Name: N'-[(3Z)-6-Methoxy-2-oxo-1-pentyl-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide

ID: Reference5281

Other Names: N-[(Z)-(6-Methoxy-2-oxo-1-pentylindol-3-ylidene)amino]benzamide;
Benzoic acid, 2-[(3Z)-1,2-dihydro-6-methoxy-2-oxo-1-pentyl-3H-indol-3-ylidene]hydrazide

Formula: C21H23N3O3

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

MDA 77 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/26/2016 1:23:10 PM
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Identificators

InChI InChI=1S/C21H23N3O3/c1-3-4-8-13-24-18-14-16(27-2)11-12-17(18)19(21(24)26)22-23-20(25)15-9-6-5-7-10-15/h5-7,9-12,14H,3-4,8,13H2,1-2H3,(H,23,25)/b22-19-
InChI Key BUSVEUMKIXHTKG-QOCHGBHMSA-N
Canonical SMILES CCCCCN1C2=C(C=CC(=C2)OC)C(=NNC(=O)C3=CC=CC=C3)C1=O
CAS 1103774215
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Other Names N-[(Z)-(6-Methoxy-2-oxo-1-pentylindol-3-ylidene)amino]benzamide;
Benzoic acid, 2-[(3Z)-1,2-dihydro-6-methoxy-2-oxo-1-pentyl-3H-indol-3-ylidene]hydrazide

In Other Databases

PubChem 25194228
ChemSpider 24719031